Chemical Properties of Diethyl 2-ethyl suberate

InChI

InChI=1S/C14H26O4/c1-4-12(14(16)18-6-3)10-8-7-9-11-13(15)17-5-2/h12H,4-11H2,1-3H3

InChI Key

XCJIKPFWCGLRHU-UHFFFAOYSA-N

Formula

C14H26O4

SMILES

CCOC(=O)CCCCCC(CC)C(=O)OCC

Molecular Weight¹

258.36

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[334.83; 758.36]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			3.92980e+01
Coefficient B			1.23016e+00
Coefficient C			-5.51800e-04
Coefficient D			4.07000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	334.83	J/mol×K	273.00	Calculated Property
Cp,gas	407.24	J/mol×K	353.78	Calculated Property
Cp,gas	473.01	J/mol×K	434.56	Calculated Property
Cp,gas	532.27	J/mol×K	515.33	Calculated Property
Cp,gas	585.15	J/mol×K	596.11	Calculated Property
Cp,gas	631.78	J/mol×K	676.89	Calculated Property
Cp,gas	672.29	J/mol×K	757.67	Calculated Property
Cp,gas	706.80	J/mol×K	838.44	Calculated Property
Cp,gas	735.45	J/mol×K	919.22	Calculated Property
Cp,gas	758.36	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0043804; 0.0001471]	Pa×s	[317.20; 566.56]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.31417e+01
Coefficient B			2.44594e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			317.20
Temperature range, max.			566.56
η	0.0043804	Pa×s	317.20	Calculated Property
η	0.0023577	Pa×s	344.91	Calculated Property
η	0.0013915	Pa×s	372.61	Calculated Property
η	0.0008834	Pa×s	400.32	Calculated Property
η	0.0005948	Pa×s	428.03	Calculated Property
η	0.0004203	Pa×s	455.74	Calculated Property
η	0.0003090	Pa×s	483.44	Calculated Property
η	0.0002349	Pa×s	511.15	Calculated Property
η	0.0001836	Pa×s	538.86	Calculated Property
η	0.0001471	Pa×s	566.56	Calculated Property

Similar Compounds

Find more compounds similar to Diethyl 2-ethyl suberate.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.